当前位置: 首页 » 资料 » 化学物质数据库 » NSC61622,7209-66-7, 1-(5-chloro-2-hydroxyphenyl)-3-quinolin-2-ylpropan

NSC61622,7209-66-7, 1-(5-chloro-2-hydroxyphenyl)-3-quinolin-2-ylpropan

放大字体  缩小字体 更新日期:2018-11-26  浏览次数:2
摘 要:NSC61622,7209-66-7, 1-(5-chloro-2-hydroxyphenyl)-3-quinolin-2-ylpropane-1,3-dione,Canonical SMILES: C1=CC=C2C(=C1)C=CC(=N2)C(=O)CC(=O)C3=C(C=CC(=C3)Cl)O,InChI: InChI=1/C18H12ClNO3/c19-12-6-8-16(21)13(9-12)17(22)10-18(23)15-7-5-11-3-,1-2-4-14(11)20-15
[Synonyms]
NSC61622
7209-66-7

[Structure]
NSC61622,7209-66-7, 1-(5-chloro-2-hydroxyphenyl)-3-quinolin-2-ylpropan

[ Properties Computed from Structure]
Molecular Weight325.74578 [g/mol]
Molecular FormulaC18H12ClNO3
XLogP4.4
H-Bond Donor1
H-Bond Acceptor4
Rotatable Bond Count4
Tautomer Count11
Exact Mass325.050571
MonoIsotopic Mass325.050571
Topological Polar Surface Area67.3
Heavy Atom Count23
Formal Charge0
Complexity456
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 1-(5-chloro-2-hydroxyphenyl)-3-quinolin-2-ylpropane-1,3-dione
Canonical SMILES: C1=CC=C2C(=C1)C=CC(=N2)C(=O)CC(=O)C3=C(C=CC(=C3)Cl)O
InChI: InChI=1/C18H12ClNO3/c19-12-6-8-16(21)13(9-12)17(22)10-18(23)15-7-5-11-3-
1-2-4-14(11)20-15/h1-9,21H,10H2

 
本文导航:
  • (1) NSC61622,7209-66-7, 1-(5-chloro-2-hydroxyphenyl)-3-quinolin-2-ylpropan
  • 下一篇:鳖甲
  • 上一篇:暂无
 
[ 资料搜索 ]  [ 加入收藏 ]  [ 告诉好友 ]  [ 打印本文 ]  [ 关闭窗口 ]

 

 
推荐图文
推荐资料
热门关注